3-[4-carbamimidoyl-2-[2-[(4-pyrrolidin-1-ylcarbonylphenyl)carbonylamino]ethoxy]phenyl]-2-oxidanylidene-propanoic acid

Systemtic Name: 3-[4-carbamimidoyl-2-[2-[(4-pyrrolidin-1-ylcarbonylphenyl)carbonylamino]ethoxy]phenyl]-2-oxidanylidene-propanoic acid Openeye Name: 3-[4-carbamimidoyl-2-[2-[[4-(pyrrolidine-1-carbonyl)benzoyl]amino]ethoxy]phenyl]-2-oxo-propanoic acid CAS Name: 3-[4-carbamimidoyl-2-[2-[[oxo-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]amino]ethoxy]phenyl]-2-oxopropanoic acid IUPAC Name: 3-[4-carbamimidoyl-2-[2-[[4-(pyrrolidine-1-carbonyl)benzoyl]amino]ethoxy]phenyl]-2-oxopropanoic acid Traditional Name: 3-[4-amidino-2-[2-[[4-(pyrrolidine-1-carbonyl)benzoyl]amino]ethoxy]phenyl]-2-keto-propionic acid Formula: C24H26N4O6 MolecularWeight: 466.48644

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)C(=O)NCCOC3=C(C=CC(=C3)C(=N)N)CC(=O)C(=O)O

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)C(=O)NCCOC3=C(C=CC(=C3)C(=N)N)CC(=O)C(=O)O

InChI

InChI=1S/C24H26N4O6/c25-21(26)18-8-7-17(13-19(29)24(32)33)20(14-18)34-12-9-27-22(30)15-3-5-16(6-4-15)23(31)28-10-1-2-11-28/h3-8,14H,1-2,9-13H2,(H3,25,26)(H,27,30)(H,32,33)